(8aR)-4-azanyl-6-oxidanylidene-2-phenylazanyl-7,8-dihydropyrrolo[1,2-a][1,3,5]triazine-8a-carboxylate

Systemtic Name: (8aR)-4-azanyl-6-oxidanylidene-2-phenylazanyl-7,8-dihydropyrrolo[1,2-a][1,3,5]triazine-8a-carboxylate Openeye Name: (8aR)-4-amino-2-anilino-6-oxo-7,8-dihydropyrrolo[1,2-a][1,3,5]triazine-8a-carboxylate CAS Name: (8aR)-4-amino-2-anilino-6-oxo-7,8-dihydropyrrolo[1,2-a][1,3,5]triazine-8a-carboxylate IUPAC Name: (8aR)-4-amino-2-anilino-6-oxo-7,8-dihydropyrrolo[1,2-a][1,3,5]triazine-8a-carboxylate Traditional Name: (8aR)-4-amino-2-anilino-6-keto-7,8-dihydropyrrolo[1,2-a][1,3,5]triazine-8a-carboxylate Formula: C13H12N5O3- MolecularWeight: 286.26608

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(N=C(N=C(N2C1=O)N)NC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

C1C[C@]2(N=C(N=C(N2C1=O)N)NC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C13H13N5O3/c14-11-16-12(15-8-4-2-1-3-5-8)17-13(10(20)21)7-6-9(19)18(11)13/h1-5H,6-7H2,(H,20,21)(H3,14,15,16,17)/p-1/t13-/m1/s1